UCSF

ZINC01609579

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 7th, 2004 10 Yes

Popular Name: 1,2,3,4-Tetramethylbenzene 1,2,3,4-Tetramethylbenzene

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CAS Numbers: 488-23-3 , 54827-17-7

Download: MOL2 SDF SMILES Flexibase

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 3.59 6.83 -2.53 0 0 0 0 134.222 0 ↓

Vendor Notes

Note Type Comments Provided By
Boiling_Point 203? Alfa-Aesar
Boiling_Point 203° Alfa-Aesar

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Analogs ( Draw Identity 99% 90% 80% 70% )

No pre-computed analogs available. Try a structural similarity search.